Geometry & MOs

Info

ID:	292986
PubChem CID:	117368753
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	246.173213
ΔH_f, kcal/mol:	-31.39
Dipole, Da:	3.67
IP(EA), eV:	-8.55(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[4-(1-azabicyclo[2.2.2]octan-3-yl)phenyl]ethanol

Drug info:

PubChemData

Smile

C1CC2=C(C1)C(=C(C=C2)CCN3CCNCC3)O

DOS

IR

Vibrations